CHEMBL145103
SMILES | N#Cc1ccc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2)cc1 |
InChIKey | VXGPTRVARWWDQI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 408.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MRGPRX1 | MRGX1 | Rat | A orphans | A | pIC50 | 5.25 | 5.72 | 6.2 | ChEMBL |
MRGPRX1 | MRGX1 | Human | A orphans | A | pIC50 | 5.73 | 5.99 | 6.25 | ChEMBL |
NK1 | NK1R | Human | Tachykinin | A | pIC50 | 6.02 | 6.02 | 6.02 | ChEMBL |